SCHEMBL5330484

SCHEMBL5330484

O=C(NCc1ccc(Cl)cc1)c1sc(Nc2cccc(F)c2)nc1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
DHODH Q02127 6/20 0.51
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
NPSR1 Q6W5P4 2/20 0.48
ALOX12 P18054 1/20 0.48
CCNA2 P20248 1/20 0.48
CDK2 P24941 1/20 0.48
ALDH1A1 P00352 3/20 0.48
PTGDR2 Q9Y5Y4 3/20 0.48
GAA P10253 2/20 0.48
MAPT P10636 2/20 0.48
KDM4E B2RXH2 2/20 0.48
POLB P06746 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
HPGD P15428 2/20 0.47
PPARG P37231 2/20 0.47
NCOA2 Q15596 2/20 0.47
NCOA1 Q15788 2/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5402536 0.93 LMNA (0.55) LMNASMN1; SMN2DHODHMEN1KMT2A
SCHEMBL5418954 0.87 LMNA (0.48) LMNASMN1; SMN2DHODHMEN1KMT2A
SCHEMBL5364912 0.82 KMT2A (0.67) LMNASMN1; SMN2DHODHMEN1KMT2A
SCHEMBL5397042 0.82 KMT2A (0.58) LMNASMN1; SMN2DHODHMEN1KMT2A
SCHEMBL14345712 0.80 CCNA2 (0.61) LMNASMN1; SMN2DHODHMEN1KMT2A
SCHEMBL5413651 0.77 PTGDR2 (0.63) LMNADHODHMEN1KMT2ANPSR1
SCHEMBL5366172 0.77 PTGDR2 (0.53) LMNASMN1; SMN2DHODHMEN1KMT2A
SCHEMBL5369173 0.77 KMT2A (0.59) LMNASMN1; SMN2DHODHMEN1KMT2A
SCHEMBL5398487 0.76 PPARA (0.49) LMNASMN1; SMN2DHODHMEN1KMT2A
SCHEMBL5354125 0.75 MEN1 (0.50) LMNASMN1; SMN2DHODHMEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007138110-A2 COMPOUNDS THAT INTERACT WITH ION CHANNELS, IN PARTICULAR WITH ION CHANNELS FROM THE KV FAMILY DEVGEN N.V. (BE) 2007-12-06 WO claimed